4-nonylphenol

4-n-Nonylphenol

104-40-5

p-Nonylphenol

4-nonyl phenol

para-Nonylphenol

Phenol, 4-nonyl-

p-n-Nonylphenol

Phenol, p-nonyl-

para Nonyl phenol

p -n -Nonylphenol

4-Nonyl-Phenol

4-n-Nonyl phenol

DTXSID5033836

CHEBI:34440

MFCD00002396

68081-86-7

4-NP

DTXCID001857

4-tert-nonylphenol

CAS-104-40-5

CCRIS 1251

HSDB 5359

EINECS 203-199-4

UNII-I03GBV4WEL

BRN 2047450

nonyl-phenol

p-nonyl phenol

p-nonyl-phenol

Para-nonyl phenol

4-Nonylphenol, tech.

Spectrum_001973

SpecPlus_000624

P-NONYLPHENOL (ENDOCRINE DISRUPTER)

Spectrum2_001832

Spectrum3_000872

Spectrum4_000712

Spectrum5_002066

4-n-Nonylphenol, 85%

4-n-Nonylphenol, 98%

I03GBV4WEL

BIDD:PXR0002

SCHEMBL15887

BSPBio_002543

KBioGR_001263

KBioSS_002539

SPECTRUM330085

3-06-00-02067 (Beilstein Handbook Reference)

BIDD:ER0006

DivK1c_006720

SPBio_001903

CHEMBL153062

KBio1_001664

KBio2_002530

KBio2_005098

KBio2_007666

KBio3_002043

4-Nonylphenol, analytical standard

Tox21_201241

Tox21_303647

BDBM50410532

CCG-39613

LMPK15010001

STL453644

AKOS015888197

MCULE-5930378829

NCGC00090918-01

NCGC00090918-02

NCGC00090918-03

NCGC00090918-05

NCGC00090918-06

NCGC00090918-07

NCGC00090918-08

NCGC00257420-01

NCGC00258793-01

PD002549

NS00010283

4-n-Nonylphenol 10 microg/mL in Acetonitrile

4-n-Nonylphenol 10 microg/mL in Cyclohexane

4-n-Nonylphenol 100 microg/mL in Cyclohexane

4-Nonylphenol, PESTANAL(R), analytical standard

SR-05000002459

J-001167

Q4545806

SR-05000002459-1

4-Nonylphenol, certified reference material, TraceCERT(R)

The Henry's Law constant for p-nonylphenol is estimated as 3.4X10-5 atm-cu m/mole(SRC) from its experimental values for vapor pressure, 8.175X10-4 mm Hg(1), and water solubility, 7 mg/l(2). This value indicates that p-nonylphenol will volatilize from water surfaces(3,SRC). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec) is estimated as approximately 1.8 days(3,SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec) is estimated as approximately 18 days(3,SRC). The volatilization half-life from a model pond (2 meters deep) can be estimated to be about 19.6 days if the effect of adsorption to sediment is ignored(4,SRC); when the effect of maximum adsorption is considered, the half-life increases to 5.8 years(4,SRC).
Literature: (1) Bidelman TF, Renberg L; Chemosphere 14: 1475-81 (1985) (2) Yalkowsky SH, Dannenfelser RM; Aquasol Database of Aqueous Solubility. Version 5 (1992) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (4) USEPA; EXAMS II Computer Simulation (1987)

The Koc of p-nonylphenol is estimated as approximately 32400(SRC), using an experimental log Kow of 5.76(1) and a regression-derived equation(2,SRC). According to a recommended classification scheme(3), this estimated Koc value suggests that p-nonylphenol will be immobile in soil(SRC).
Literature: (1) Itokawa H et al; Chem Pharm Bull 37: 1619-21 (1989) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 23 (1983)

2-ETHYL-5-METHYLPYRAZINE

13360-64-0

Pyrazine, 2-ethyl-5-methyl-

2-Methyl-5-ethylpyrazine

5-ethyl-2-methylpyrazine

2-Ethyl-5-methyl pyrazine

FEMA No. 3154

2,5-Methylethylpyrazine

2-Ethyl-5-methylpyrazine, 9CI, 8CI

Pyrazine, 5-ethyl-2-methyl

W41R8X574D

2-Ethyl-5-methylpyrazine(contains 2-Ethyl-6-methylpyrazine)

BRN 0956719

EINECS 236-416-6

UNII-W41R8X574D

AI3-34443

2-Ethyl-5-methyl-pyrazine

CHEMBL94558

SCHEMBL110053

DTXSID6065422

FEMA 3154

5-METHYL-2-ETHYLPYRAZINE

CHEBI:141542

EINECS 253-175-2

ETHYL-5-METHYLPYRAZINE, 2-

MFCD09039261

AKOS006272101

2-ETHYL-5-METHYLPYRAZINE [FHFI]

AS-50066

NS00021609

E78081

A806643

W-108295

Q27292273

98% pound mixture of 2-Ethyl-5-methylpyrazine and 2-ethyl-6-methylpyrazine pound(c)

2,5-DIMETHYLPYRAZINE

123-32-0

2,5-Dimethyl pyrazine

Pyrazine, 2,5-dimethyl-

2,5-Dimethyl-1,4-diazine

2,5-Dimethylpiazine

2,5-Dimethylparadiazine

NSC 49139

FEMA No. 3272

2,5-Dimethyl-pyrazine

V99Y0MUY1Q

PYRAZINE,2,5-DIMETHYL

CHEBI:89762

MFCD00006147

NSC-49139

CCRIS 2929

2,5-Dimethylpyrazine (natural)

EINECS 204-618-3

UNII-V99Y0MUY1Q

Ketine

AI3-60303

2.5-dimethylpyrazine

2, 5-Dimethylpyrazine

pyrazine, 2,5-dimethyl

SCHEMBL82304

2,5-Dimethylpyrazine, 98%

CHEMBL94709

DTXSID6047652

FEMA 3272

WLN: T6N DNJ B1 E1

2,5 and 2,6-dimethyl pyrazine

AMY23196

BCP08618

NSC49139

2,5-DIMETHYLPYRAZINE [FCC]

2,5-DIMETHYLPYRAZINE [FHFI]

2,5-Dimethylpyrazine, >=98%, FG

AKOS003368403

CS-W019957

MCULE-2763393473

NCGC00184236-01

NCGC00184236-02

2,5-Dimethylpyrazine, analytical standard

AC-10703

AS-17251

HY-34439

DB-003236

2,5-Dimethylpyrazine (contains 2,6-isomer)

D1526

D2171

NS00012335

S3108

EN300-20206

2,5-dimethylpyrazine and 2,6-dimethylpyrazine

P19770

A805045

Q-100107

Q27161950

F0001-0364

Z104477264

InChI=1/C6H8N2/c1-5-3-8-6(2)4-7-5/h3-4H,1-2H

25R

3-Ethyl-2,5-dimethylpyrazine

13360-65-1

2-Ethyl-3,6-dimethylpyrazine

Pyrazine, 3-ethyl-2,5-dimethyl-

2,5-DIMETHYL-3-ETHYLPYRAZINE

G2FB13VLOG

3,6-Dimethyl-2-ethylpyrazine

3,6-cocoa pyrazine

UNII-G2FB13VLOG

EINECS 236-417-1

CHEMBL95123

SCHEMBL160005

2E3,6DMP

2-ethyl-3,6-dimethyl pyrazine

DTXSID1065423

CHEBI:199156

Pyrazine, 2-ethyl-3,6-dimethyl

Pyrazine, 2-ethyl-3,?-dimethyl-

2-Ethyl-3,5/6-dimethyl-Pyrazine

AKOS006271522

BS-14917

DB-117250

FEMA NO. 3149, 3,6-DIMETHYL-

CS-0152557

NS00012398

F20894

A902157

W-108294

Q27278651

3-Ethyl-2,5-dimethylpyrazine; 2,5-Dimethyl-3-ethylpyrazine; 3,6-Dimethyl-2-ethylpyrazine;

FURFURAL

2-Furaldehyde

furan-2-carbaldehyde

98-01-1

2-Furancarboxaldehyde

Furaldehyde

Furfuraldehyde

Fural

2-Formylfuran

2-Furanaldehyde

2-Furancarbonal

Furancarbonal

Furfurole

2-Furfural

Furfurylaldehyde

2-Furfuraldehyde

Pyromucic aldehyde

Furale

Furole

Furol

2-Furylaldehyde

2-Furylcarboxaldehyde

2-Furyl-methanal

Furfurale

Furyl-methanal

2-Furylmethanal

2-Furil-metanale

Furan-2-carboxaldehyde

2-furancarbaldehyde

Quakeral

Fufural

alpha-Furole

2-Formylofuran

2-Formyl furan

2-Furankarbaldehyd

Nci-C56177

alpha-Furfuraldehyde

Furfural (natural)

Rcra waste number U125

Furaldehydes

Caswell No. 466

FEMA No. 2489

furan-2-aldehyde

NSC 8841

CCRIS 1044

HSDB 542

CHEBI:34768

UNII-DJ1HGI319P

.alpha.-Furole

EINECS 202-627-7

DJ1HGI319P

MFCD00003229

EPA Pesticide Chemical Code 043301

BRN 0105755

2-furancarboxyaldehyde

DTXSID1020647

AI3-04466

NSC-8841

DTXCID50647

EC 202-627-7

5-17-09-00292 (Beilstein Handbook Reference)

NCGC00091328-01

FURFURAL (IARC)

FURFURAL [IARC]

Furfurale [Italian]

2-Formylofuran [Polish]

2-Furankarbaldehyd [Czech]

CAS-98-01-1

2-Furil-metanale [Italian]

UN1199

RCRA waste no. U125

Hydrojasmal

Furfuralu

a-furfuraldehyde

Qo furfural

a-Furole

alpha-furaldehyde

2-furanal

Furfural ACS grade

furan-2 carbaldehyde

FURFURALDEHYDES

Furfural, 99%

2-Furaldehyde, 8CI

2-furan-carboxaldehyde

2-Furanocarboxyaldehyde

FURFURAL [FHFI]

FURFURAL [HSDB]

FURFURAL [INCI]

FURFURAL [FCC]

FURFURAL [MI]

2-Furylaldehyde xypropane

U1199

WLN: T5OJ BVH

BIDD:ER0698

FURAL/PYROMUCIC ALDEHYDE

Furfural, ACS reagent, 99%

CHEMBL189362

QSPL 006

QSPL 102

FEMA 2489

Furan-2-carbaldehyde (Furfural)

NSC8841

Furfural, >=98%, FCC, FG

Furfural, for synthesis, 98.0%

STR00358

Tox21_111114

Tox21_202191

Tox21_300170

BDBM50486229

Furaldehydes [UN1199] [Poison]

STL283124

AKOS000118907

AM81812

Furfural, analytical reference material

MCULE-5757882837

Furfural 100 microg/mL in Acetonitrile

USEPA/OPP Pesticide Code: 043301

Furfural, natural, >=98%, FCC, FG

Furfural, SAJ first grade, >=99.0%

NCGC00091328-02

NCGC00091328-03

NCGC00091328-04

NCGC00253954-01

NCGC00259740-01

BP-31002

DB-003668

CS-0015696

F0073

NS00003316

EN300-18110

ASCORBIC ACID IMPURITY A [EP IMPURITY]

A845786

Q412429

F1294-0048

InChI=1/C5H4O2/c6-4-5-2-1-3-7-5/h1-4

furfural; furfuraldehyde; furfurol; 2-furaldehyde; 2-furancarboxaldehyde; furan-2-carboxaldehyde

The Henry's Law constant for furfural is estimated as 3.8X10-6 atm-cu m/mole(SRC) derived from its vapor pressure, 2.21 mm Hg(1), and water solubility, 7.41X10+4 mg/L(2). This Henry's Law constant indicates that furfural is expected to volatilize from water surfaces(3). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(3) is estimated as 9.6 days(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(3) is estimated as 73 days(SRC). Furfural's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of furfural from dry soil surfaces may exist(SRC) based upon its vapor pressure(1).
Literature: (1) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, DC: Taylor and Francis (1989) (2) Yalkowsky SH, He Y, eds; Handbook of aqueous solubility data. Boca Raton, FL: CRC Press p. 140 (2003) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)

The Koc of furfural is estimated as 40(SRC), using a log Kow of 0.41(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that furfural is expected to have very high mobility in soil.
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 11 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983)

2-NAPHTHOL

naphthalen-2-ol

135-19-3

beta-naphthol

2-Naphthalenol

Betanaphthol

2-Hydroxynaphthalene

Isonaphthol

Developer A

Developer BN

Naphthol B

2-Naphtol

Azogen developer A

beta-Naphtol

beta-Napthol

Developer AMS

beta-Hydroxynaphthalene

2-Naftolo

2-Naftol

Developer sodium

C.I. Developer 5

.beta.-Naphthol

beta-Naphthyl alcohol

beta-Monoxynaphthalene

beta-Naftol

beta-Naftolo

beta-Naphthyl hydroxide

NAPHTHOL, BETA

C.I. Azoic Coupling Component 1

.beta.-Hydroxynaphthalene

Antioxygene BN

.beta.-Naftolo

.beta.-Naphtol

.beta.-Napthol

.beta.-Naftol

NSC 2044

C.I. 37500

MFCD00004067

.beta.-Naphthyl alcohol

.beta.-Monoxynaphthalene

.beta.-Naphthyl hydroxide

P2Z71CIK5H

CHEMBL14126

2-Naphthol(Flakes or Chunks)

DTXSID5027061

CHEBI:10432

Naphthalen-2-ol (beta-Naphthol)

NSC-2044

DTXCID907061

2-Naftol [Dutch]

beta-Naftol [Dutch]

2-Naphtol [French]

Caswell No. 590

2-Naftolo [Italian]

beta-Naphtol [German]

beta-Naftolo [Italian]

2-Napththol

CAS-135-19-3

Betanaphthol [NF]

HSDB 6812

EINECS 205-182-7

UNII-P2Z71CIK5H

EPA Pesticide Chemical Code 010301

Hydronaphthol

Naphthols

AI3-00081

2-napthol

napthalen-2-ol

2-naphthylalcohol

naphth-2-ol

Naphthol, .beta.

03V

EINECS 215-322-9

2-hydroxy naphthalene

2-Naphthol, Reagent

2-Naphthol, Purified

BRN 1817321

2-Naphthol, 98%

2-Naphthol, 99%

Naphth-2-ol, 10

beta.-hydroxynaphthalene

Microcidin (Salt/Mix)

BETANAPHTHOL [II]

2-NAPHTHOL [MI]

2-Naphthol, 98.5%

BETANAPHTHOL [HSDB]

EC 205-182-7

2-NAPHTHOL [INCI]

SCHEMBL28781

WLN: L66J CQ

BETANAPHTHOL [MART.]

BETANAPHTHOL [WHO-DD]

SGCUT00131

2-Naphthol, LR, >=98%

NSC2044

4b32

Sodium 2-naphthoxide (Salt/Mix)

HMS3264N15

Pharmakon1600-01504501

HY-Y0110

to_000010

Tox21_201884

Tox21_303038

BDBM50159250

NSC758883

s6035

STL281866

AKOS000119842

AM86551

CCG-213932

HR-0304

MCULE-2675031485

NSC-758883

2-Naphthol, purum, >=98.0% (GC)

NCGC00249132-01

NCGC00257077-01

NCGC00259433-01

AC-10464

2-Naphthol, BioXtra, >=99.0% (GC)

SBI-0207084.P001

2-Naphthol, SAJ first grade, >=98.0%

TOLNAFTATE IMPURITY A [EP IMPURITY]

CS-0008403

N0027

NS00003415

EN300-18025

2-Naphthol, fluorescence indicator, >=99.0%

D86186

AB01314260_03

4-06-00-04208 (Beilstein Handbook Reference)

A806896

AB-131/40299865

Q949232

SR-01000872753

Q-200736

SR-01000872753-1

BRD-K21164796-001-01-0

Z57127515

F0001-0455

InChI=1/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11

26716-78-9

The Henry's Law constant for 2-naphthol is as 2.74X10-8 atm-cu m/mole(1). This Henry's Law constant indicates that 2-naphthol is expected to be essentially nonvolatile from water surfaces(2). 2-Naphthol's Henry's Law constant indicates that volatilization from moist soil surfaces for the neutral species may not occur(SRC). 2-Naphthol is not expected to volatilize from dry soil surfaces(SRC) based upon an extrapolated vapor pressure of 3.2X10-4 mm Hg(3).
Literature: (1) Abraham MH et al; J. Pharm. Sci. 83: 1085-100 (1994) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Boublik T et al; The Vapor Pressure of Pure Substances: Selected Values of the Temperature Dependence of the Vapor Pressures of some Pure Substances in the Normal and Low Pressure Region Vol 17. Amsterdam, Netherlands: Elsevier Sci Publ p 768 (1984)

The Koc of 2-naphtol is estimated as 390(SRC), using a log Kow of 2.7(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that 2-naphthol is expected to have moderate mobility in soil. The pKa of 2-naphthol is 9.51(4), indicating that this compound will exist partially in the anion form in the environment and anions generally do not adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(5).
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 66 (1995) (2) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Nov, 2012. Available from, as of Oct 14, 2014: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (3) Swann RL et al; Res Rev 85: 17-28 (1983) (4) Bhattacharyya D et al; Haz. Waste Haz. Mater 3: 405-29 (1986) (5) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000)

2-Propenal, 3-(1-aziridinyl)-3-(dimethylamino)-

NRCJELUZOZAJPC-XVNBXDOJSA-N

(2E)-3-(1-Aziridinyl)-3-(dimethylamino)-2-propenal #

Cyclohexene,4-butyl-

4-Butyl-1-cyclohexene

21524-26-5

4-Butyl-cyclohexene

4-Butylcyclohexene-1

4-Butylcyclohex-1-ene

Cyclohexene, 4-butyl-

DTXSID00944132

JVPPGMNHTVHMES-UHFFFAOYSA-N

3-Hexadecene, (Z)-

cis-3-Hexadecene

3-Hexadecene, (3Z)-

(Z)-3-Hexadecene

(3Z)-3-Hexadecene

UNII-U767201ISR

34303-81-6

U767201ISR

Q27290783

1-PENTADECENE

13360-61-7

Pentadec-1-ene

Pentadecene

PENTADECENE,1-

C15H30

KH577LIA74

MFCD00008987

NSC-77125

27251-68-9

CCRIS 5721

1-Pentadecene, 98%

EINECS 236-414-5

NSC 77125

UNII-KH577LIA74

UNII-2M9QW46A8B

2M9QW46A8B

DTXSID1065421

CHEBI:77506

NSC77125

EINECS 248-364-1

LMFA11000327

AKOS015912787

MCULE-8648825393

AS-56500

DB-042190

CS-0186359

NS00020262

P0627

S0345

D83561

J-006413

Q3374882

7H-PYRAZOLO[4,3-D]PYRIMIDIN-7-ONE,1,4-DIHYDRO-

1-TETRADECENE

Tetradec-1-ene

1120-36-1

Tetradecene

n-Tetradec-1-ene

1-Tetradecylene

alpha-Tetradecene

1-butadecene

Neodene 14

CCRIS 3785

HSDB 1087

AI3-10509

EINECS 214-306-9

NSC 66434

.alpha.-Tetradecene

UNII-FW23481S7S

DTXSID4027367

CHEBI:77505

FW23481S7S

NSC-66434

DTXCID907367

Alkenes, C10-16 .alpha.-

EC 214-306-9

MFCD00008981

1-Tetradecene [Standard Material for GC]

68855-58-3

dodecylethylene

a-Tetradecene

aplha-Tetradecene

Tetradecene-1

NSC66434

TETRADECENE [INCI]

Alkenes, C14-18 alpha-

Alkenes, C14-20 alpha-

1-TETRADECENE [HSDB]

CHEMBL1892257

1-Tetradecene, analytical standard

BAA12036

EINECS 272-493-2

EINECS 272-494-8

Tox21_303051

LMFA11000329

1-Tetradecene, >=97.0% (GC)

1-Tetradecene, technical grade, 92%

AKOS015904124

MCULE-5148675782

NCGC00164372-01

NCGC00257042-01

LS-14356

CAS-1120-36-1

CS-0314332

NS00005576

T0087

J-002695

Q27147080

25608-58-6

Based on an estimated Henry's Law constant of 8.48 atm-cu m/mole at 25 deg C(1,SRC), 1-tetradecene is expected to rapidly volatilize from water and moist soil to the atmosphere. The estimated half-life for volatilization from a model river 1 m deep flowing at 1 m/sec with a wind speed of 3 m/sec is 4.1 hrs(2,SRC). Its expected strong adsorption to soil and sediment may attenuate the rate of this process(SRC). The estimated half-life for volatilization from a model pond, which takes into account adsorptive processes, is 7.3 months(3,SRC). The vapor pressure of 1-tetradecene, 1.5X10-2 mm Hg at 25 deg C(4) indicates that volatilization from dry soil will not be an important fate process(SRC).
Literature: (1) Meylan WM, Howard PH; Environ Toxicol Chem 10: 1283-93 (1991) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods NY: McGraw-Hill Chapt 15 (1982) (3) USEPA; EXAMS II (1987) (4) Daubert TE, Danner RP; Physical & Thermodynamic Properties of Pure Chemicals NY, NY: Hemisphere Pub Corp (1989)

Estimated soil adsorption coefficients ranging from 19,700 to 32,300 can be calculated for 1-tetradecene using appropriate regression equations(1) and its estimated water solubility, 4.0X10-4 mg/L at 25 deg C(1,SRC) obtained from a vapor pressure of 1.5X10-2 mm Hg at 25 deg C(2) and estimated Henry's Law constant of 8.48 atm-cu m/mole at 25 deg C(3,SRC), and its estimated octanol/water partition coefficient, 7.3(1,SRC), obtained from its estimated water solubility. These soil adsorption coefficients indicate that 1-tetradecene will be essentially immobile in soil(4).
Literature: (1) Lyman WJ et al; Handbook of Chemical Property Estimation Methods NY: McGraw-Hill Chapt 2, 5 & 15 (1982) (2) Daubert TE, Danner RP; Physical & Thermodynamic Properties of Pure Chemicals NY, NY: Hemisphere Pub Corp (1989) (3) Meylan WM, Howard PH; Environ Toxicol Chem 10: 1283-93 (1991) (4) Swann RL et al; Res Rev 85: 17-28 (1983)

52097-85-5

Cyclobutene, 2-propenylidene-

(3E)-3-prop-2-enylidenecyclobutene

Cyclobutene, 3-(2-propen-1-ylidene)-

USDJJNZZCBONHN-DAXSKMNVSA-N

DB-247012

(3E)-3-(2-Propenylidene)-1-cyclobutene #

1H-Benzotriazole

Benzotriazole

95-14-7

1,2,3-BENZOTRIAZOLE

1H-Benzo[d][1,2,3]triazole

2H-Benzotriazole

Azimidobenzene

1H-1,2,3-Benzotriazole

Aziminobenzene

Benztriazole

Benzisotriazole

Benzene azimide

Cobratec #99

2,3-Diazaindole

1,2-Aminoazophenylene

1,2,3-Triazaindene

2H-benzo[d][1,2,3]triazole

Cobratec 99

273-02-9

1,2,-Aminozophenylene

1,2,3-Triaza-1H-indene

Cobratec 35G

NSC-3058

1,2,3-1h-benzotriazole

Verzone Crystal

NCI-C03521

Kemitec TT

Rusmin R

Seetec BT

CCRIS 78

27556-51-0

DTXSID6020147

U-6233

CHEBI:75331

HSDB 4143

EINECS 202-394-1

UNII-86110UXM5Y

BRN 0112133

AI3-15984

86110UXM5Y

MFCD00005699

DTXCID00147

EC 202-394-1

4-26-00-00093 (Beilstein Handbook Reference)

1H-Benzotriazol

Benzotriazole (VAN)

Entek

BtaH

CAS-95-14-7

Pseudoazimidobenzene

Irgastab I 489

1,2,3-Benzotriazole,1H-benzo[d][1,2,3]triazole

azaindazole

benzotriazol

ISK 3

aza-indazole

3uzj

1 h-benzotriazole

1,3-Triazaindene

0CT

1,3-Benzotriazole

Cobratec No. 99

1,2-Aminozophenylene

1,2,3-Benztriazole

1H-1,3-Benzotriazole

1,3-Triaza-1H-indene

1H-Benzotriazole (VAN8C

WLN: T56 BMNNJ

SCHEMBL8956

1H-BT

BENZOTRIAZOLE [INCI]

MLS002302971

CHEMBL84963

1H-benzo-[1,2,3]triazole

D 32-108

1H-BENZOTRIAZOLE [MI]

BDBM36293

NSC3058

Benzotriazole, analytical standard

HMS3091M10

AMY37120

Benzotriazole, reagent grade, 97%

CS-D1407

HY-Y0688

STR01561

Tox21_201501

Tox21_302934

BDBM50234613

STL281967

Benzotriazole, ReagentPlus(R), 99%

1,2,3-BENZOTRIAZOLE [HSDB]

1H-Benzotriazole, >=98.0% (N)

4-HYDROXY-2-METHOXYBENZYLAMINE

AKOS000119181

AKOS025396849

MCULE-2848618742

PS-3644

NCGC00091322-01

NCGC00091322-02

NCGC00091322-03

NCGC00256574-01

NCGC00259052-01

BP-21454

SMR001252218

DB-022595

B0094

NS00010261

Benzotriazole, Vetec(TM) reagent grade, 98%

EN300-17964

D77352

AB00374479-06

AC-907/34124039

Q220672

W-100172

Z57127352

F2190-0645

InChI=1/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9

BTR

The Henry's Law constant for 1,2,3- benzotriazole is estimated as 3.2X10-7 atm-cu m/mole(SRC) derived from its vapor pressure, 0.04 mm Hg(1), and water solubility, 19,800 mg/l(1). This Henry's Law constant indicates that 1,2,3-benzotriazole is expected to be essentially nonvolatile from water surfaces(2). 1,2,3-Benzotriazole is not expected to volatilize from dry soil surfaces(SRC) based upon its vapor pressure(1). The pKa of benzotriazole is 8.37(3), indicating that this compound will exist in the cation form in the environment. Volatilization from dry or moist soil surfaces is not expected to be an important fate process because the cation is not expected to volatilize.
Literature: (1) Davis LN et al; Investigation of selected potential environmental contaminants: benzotriazoles. Washington, DC: USEPA-560/ 2-77-001 (1977) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Serjeant EP Dempsey B; Ionisation constants of organic acids in aqueous solution; IUPAC Chemical Data Series, no 23. NY, NY; Pergamon Press p. 159 (1979)

The Koc of 1,2,3-benzotriazole is estimated as 145(SRC), using a log Kow of 1.44(1) and a regression-derived equation(2). According to a classification scheme(3), these estimated Koc values suggests that 1,2,3- benzotriazole is expected to have high mobility in soil. However, mobility of 1,2,3-benzotriazole will be affected by pH(2): the pKa of benzotriazole is 8.37(4), indicating that this compound will exist in the cation form in the environment and cations generally adsorb to organic carbon and clay more strongly than their neutral counterparts.
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 18 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983) (4) Serjeant EP Dempsey B; Ionisation constants of organic acids in aqueous solution; IUPAC Chemical Data Series, no 23. NY, NY; Pergamon Press p. 159 (1979)

Dimethyl trisulfide

3658-80-8

Trisulfide, dimethyl

Methyl trisulfide

DIMETHYLTRISULFIDE

2,3,4-Trithiapentane

Dimethyl trisulphide

(methyltrisulfanyl)methane

dimethyltrisulfane

DMTS

FEMA No. 3275

CH3SSSCH3

3E691T3NL1

NSC-97324

UNII-3E691T3NL1

Dimethyl trisufide

EINECS 222-910-9

2,4-Trithiapentane

NSC 97324

trisulfane, dimethyl-

1,3-Dimethyltrisulfane

AI3-26172

1,3-Dimethyltrisulfane #

SCHEMBL446658

methylsulfanyldisulfanyl-methane

CHEBI:4614

DTXSID9063118

DIMETHYL TRISULFIDE [FHFI]

Dimethyl trisulfide, >=98%, FG

NSC97324

MFCD00039808

NSC801680

s6311

AKOS015897465

NSC-801680

2,3,4-Trithiapentane; NSC 97324

Dimethyl trisulfide, analytical standard

BS-43830

1,3-Dimethyltrisulfane (ACD/Name 4.0)

DB-003633

HY-128454

CS-0099182

D3418

NS00022106

C08372

D90187

InChI=1/C2H6S3/c1-3-5-4-2/h1-2H

A823301

Q-100435

Q5277321

FLAMMABLE LIQUID, N.O.S. (DIMETHYL TRISULPHIDE)